SCHEMBL31684784

SCHEMBL31684784

C=CC(=O)Nc1cccc(Nc2nc(Nc3ccc(N4CCN(C)CC4)cc3)ncc2F)c1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 12/20 0.72
SRC P12931 2/20 0.72
TEC P42680 1/20 0.72
SLK Q9H2G2 1/20 0.72
ITK Q08881 4/20 0.72
BRD4 O60885 2/20 0.68
BTK Q06187 4/20 0.68
JAK3 P52333 3/20 0.68
JAK2 O60674 1/20 0.65
BLK P51451 1/20 0.65
BMX P51813 1/20 0.65

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28980983 1.00 EGFR (0.72) EGFRSRCTECSLKITK
SCHEMBL28980992 0.93 BRD4 (0.72) EGFRSRCTECSLKITK
SCHEMBL18371448 0.90 BRD4 (0.78) EGFRSRCTECSLKITK
SCHEMBL28980968 0.90 BTK (0.80) EGFRSRCTECSLKBRD4
SCHEMBL31684778 0.90 BTK (0.80) EGFRSRCTECSLKBRD4
SCHEMBL31684788 0.90 BRD4 (0.78) EGFRSRCTECSLKITK
SCHEMBL16391083 0.90 EGFR (0.78) EGFRSRCTECSLKITK
SCHEMBL17002254 0.89 EGFR (0.85) EGFRSRCTECSLKBRD4
SCHEMBL12518570 0.87 EGFR (0.82) EGFRTECITKBTKJAK3
SCHEMBL28980984 0.87 SRC (0.82) SRCBRD4BTK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4617261-A1 2,4,5-TRISUBSTITUTED PYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Wenzhou Medical University (CN) 2025-09-17 EP claimed